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115338-37-9 | Cyclopentanone, 2-[2-(1-naphthalenyl)propyl]-
CAS No: 115338-37-9 Catalog No: AG000GMG MDL No:
Product Description
Catalog Number:
AG000GMG
Chemical Name:
Cyclopentanone, 2-[2-(1-naphthalenyl)propyl]-
CAS Number:
115338-37-9
Molecular Formula:
C18H20O
Molecular Weight:
252.3508
IUPAC Name:
2-(2-naphthalen-1-ylpropyl)cyclopentan-1-one
InChI:
InChI=1S/C18H20O/c1-13(12-15-8-5-11-18(15)19)16-10-4-7-14-6-2-3-9-17(14)16/h2-4,6-7,9-10,13,15H,5,8,11-12H2,1H3
InChI Key:
IGAQEZNXMIFXDX-UHFFFAOYSA-N
SMILES:
O=C1CCCC1CC(c1cccc2c1cccc2)C
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.151g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.357g/mol
Monoisotopic Mass:
252.151g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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